3-[(2S)-2-chloranylpropyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 3-[(2S)-2-chloranylpropyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-[(2S)-2-chloropropyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-[(2S)-2-chloropropyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 3-[(2S)-2-chloropropyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-[(2S)-2-chloropropyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C12H14ClN2O+ MolecularWeight: 237.70536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC=C(C2=O)CC(C)Cl

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC=C(C2=O)C[C@H](C)Cl

InChI

InChI=1S/C12H13ClN2O/c1-8(13)6-10-7-14-11-5-3-4-9(2)15(11)12(10)16/h3-5,7-8H,6H2,1-2H3/p+1/t8-/m0/s1